Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | CDC7 | O00311 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4414124 | 1.00 | PARP1 (0.46) | PARP1CDC7KDM4EALDH1A1GAA | |
| SCHEMBL3427703 | 0.98 | PARP1 (0.47) | PARP1CDC7KDM4EALDH1A1GAA | |
| SCHEMBL3427967 | 0.95 | PARP1 (0.47) | PARP1CDC7KDM4EALDH1A1GAA | |
| SCHEMBL2395933 | 0.92 | PARP1 (0.50) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28059195 | 0.85 | KDM4E (0.51) | KDM4EALDH1A1GAAMAPTRAB9A | |
| SCHEMBL5083476 | 0.84 | OPRL1 (0.46) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL3963175 | 0.83 | P2RX7 (0.53) | KDM4EALDH1A1GAARAB9AMEN1 | |
| SCHEMBL3955549 | 0.82 | PARP1 (0.52) | PARP1KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30767818 | 0.81 | MAPT (0.48) | KDM4EALDH1A1GAAHPGDHSD17B10 | |
| SCHEMBL29373648 | 0.81 | ALDH1A1 (0.42) | PARP1KDM4EALDH1A1HPGDHSD17B10 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022188203-A1 | IMIDAZOPYRIDINE DERIVATIVE | 北京富龙康泰生物技术有限公司 | 2022-09-15 | — | — | WO | disclosed |